SCHEMBL7690125

SCHEMBL7690125

N#CNC1=Nc2ccc(-c3ccc(C#N)s3)cc2C12CCCCC2

nearest known ligand 0.54

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
PGR P06401 17/20 0.54
NR3C1 P04150 1/20 0.34
AR P10275 1/20 0.34
BACE1 P56817 1/20 0.33
INPPL1 O15357 1/20 0.31
MELK Q14680 1/20 0.30

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL7684267 0.83 PGR (0.56) PGRNR3C1AR
SCHEMBL7646011 0.83 PGR (0.54) PGRNR3C1AR
SCHEMBL6013827 0.77 PGR (0.49) PGR
SCHEMBL7646020 0.75 PGR (0.55) PGRNR3C1ARBACE1
SCHEMBL5226807 0.70 PGR (0.75) PGR
SCHEMBL4110098 0.70 PGR (1.00) PGRNR3C1
SCHEMBL4109221 0.69 PGR (0.72) PGRNR3C1AR
SCHEMBL4109225 0.69 PGR (0.72) PGRNR3C1AR
SCHEMBL4103309 0.68 PGR (0.71) PGRNR3C1AR
SCHEMBL4103305 0.68 PGR (0.71) PGRNR3C1AR

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6355648-B1 COMPOUNDS AS CONTRACEPTIVES AND PROGESTERONE ANTAGONIST AMERICAN HOME PRODUCTS CORPORATION 2002-03-12 US disclosed